Chemical Properties of Phosphorothioic acid, O-(1,6-dihydro-6-oxo-1-phenyl-3-pyridazinyl) O,O-diethyl ester (CAS 119-12-0)

Phosphorothioic acid, O-(1,6-dihydro-6-oxo-1-phenyl-3-pyridazinyl) O,O-diethyl ester

InChI
InChI=1S/C14H17N2O4PS/c1-3-18-21(22,19-4-2)20-13-10-11-14(17)16(15-13)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3
InChI Key
CXJSOEPQXUCJSA-UHFFFAOYSA-N
Formula
C14H17N2O4PS
SMILES
CCOP(=S)(OCC)Oc1ccc(=O)n(-c2ccccc2)n1
Molecular Weight1
340.33
CAS
119-12-0
Other Names
  • Pyridafenthion
  • Phosphorothioic acid, O,O-diethyl ester, O-ester with 6-hydroxy-2-phenyl-3(2H)pyridazinone
  • American cyanamid 12,503
  • CL 12503
  • O,O-Diethyl O-(2,3-dihydro-3-oxo-2-phenyl-6-pyridazinyl)phosphorothioate
  • O,O-Diethylphosphorothioate, O-ester with 6-hydroxy-2-phenyl-3(2H)-pyridazinone
  • O-(1,6-Dihydro-6-oxo-1-phenylpyridazin-3-yl) O,O-diethyl phosphorothioate
  • ENT 23,968
  • Ofnack
  • Ofnak
  • Ofunack
  • Pyridaphenthion
  • 3(2H)-Pyridazinone, 6-hydroxy-2-phenyl-, O-ester with O,O-diethyl phosphorothioate
  • O,O-diethyl O-(1,6-dihydro-6-oxo-1-phenylpyridazin-3-yl) thiophosphate
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Physical Properties

Property Value Unit Source
logPoct/wat 2.909 Crippen Calculated Property
McVol 240.850 ml/mol McGowan Calculated Property
Inp [2418.00; 2478.00]   Show Hide
Inp 2418.00 NIST
Inp 2437.00 NIST
Inp 2478.00 NIST
Inp 2455.00 NIST
Inp 2437.00 NIST
Inp 2450.00 NIST
Inp 2437.00 NIST
Inp 2455.00 NIST
Inp 2418.00 NIST
Tfus 306.70 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Pyridaphenthion oxon. Cytosine arabinoside, methyl-TMS derivative. 10-Methoxy-14-methyl-5-oxo-5,7,8,14-tetrahydro-indolo-[2,3-c]-quinazo-[3,2,a]-pyridine. narwedine. Cytidine, methyl-TMS derivative. Cytosine arabinoside, dimethyl-propyldimethylsilyl derivative. 6H-Benzofuro[3a,3,2-ef][2]benzazepin-6-one, 4a,5,9,10,11,12-hexahydro-3-methoxy-11-methyl-, (4aS,8aS)-. 5-Methylcytosine riboside, TMS. 11-nor-D9-Tetrahydrocannabinol-9-carboxylic acid. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 2. Hydromorphone. 2'-Deoxyguanosine, tris(trimethylsilyl) deriv.. Hydrocodone. Adenosine, N-(trimethylsilyl)-2',3'-bis-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. DIHYDROMORPHINE.

Find more compounds similar to Phosphorothioic acid, O-(1,6-dihydro-6-oxo-1-phenyl-3-pyridazinyl) O,O-diethyl ester.

Sources

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